Geometry & MOs

Info

ID:	231287
PubChem CID:	87573370
Reduced:	ClO2N9C27H34 (1)
Stoich.:	AB2C9D27E34 (1)
Weight, g/mol:	370.30831
ΔH_f, kcal/mol:	-1.06
Dipole, Da:	11.13
IP(EA), eV:	-9.24(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(11-methyldodecoxy)-9-oxononanoic acid

Drug info:

PubChemData

Smile

C1C[C@H](C[C@H]1C(=O)NC2CCC(CC2)NC3=NN4C(=CN=C4C(=C3)NC5CC5)C(=O)NC6=CC(=NC=C6)Cl)N

DOS

IR

Vibrations